==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE/IMMUNE SYSTEM 03-MAY-12 4F00 . COMPND 2 MOLECULE: CHAPERONE PROTEIN DNAK; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.ZAHN,N.STRAETER . 226 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12570.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 168 74.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 47 20.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 21 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 77 34.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 0 0 1 0 0 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 0 1 0 1 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 389 A V 0 0 162 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 143.0 66.6 121.4 46.3 2 390 A L + 0 0 179 1,-0.1 2,-0.3 0, 0.0 0, 0.0 0.547 360.0 31.9 -93.1 -13.2 65.5 123.7 43.5 3 391 A L - 0 0 142 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.947 61.3-164.2-143.0 148.8 65.5 120.8 41.1 4 392 A L - 0 0 114 -2,-0.3 2,-0.6 -3,-0.1 25,-0.0 -0.981 22.5-132.2-129.7 144.0 64.7 117.0 41.2 5 393 A D + 0 0 106 -2,-0.3 25,-1.6 25,-0.3 2,-0.3 -0.871 41.0 169.6 -90.0 127.7 65.7 114.6 38.4 6 394 A V B -A 29 0A 60 -2,-0.6 23,-0.2 23,-0.2 20,-0.1 -0.941 41.9 -97.1-135.3 155.8 62.6 112.6 37.8 7 395 A T - 0 0 9 21,-2.5 20,-3.7 -2,-0.3 21,-0.2 -0.602 26.7-161.4 -72.3 126.7 61.5 110.1 35.2 8 396 A P S S+ 0 0 49 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.705 75.5 30.1 -82.9 -17.2 59.5 111.9 32.6 9 397 A L S S- 0 0 0 16,-0.1 19,-0.2 19,-0.1 18,-0.1 -0.961 91.0 -98.3-138.8 153.7 58.0 108.7 31.4 10 398 A S - 0 0 10 -2,-0.3 45,-2.4 45,-0.1 2,-0.4 -0.405 37.2-147.4 -64.2 152.9 57.1 105.3 32.8 11 399 A L E +BC 24 54B 11 13,-3.6 13,-3.1 43,-0.2 12,-3.0 -0.969 35.2 109.9-126.9 138.8 59.6 102.5 32.3 12 400 A G E -BC 22 53B 0 41,-2.8 41,-3.5 -2,-0.4 2,-0.3 -0.860 49.4 -76.2-173.0-159.1 58.9 98.8 31.8 13 401 A I E -BC 21 52B 0 8,-2.4 8,-3.2 -2,-0.2 2,-0.4 -0.921 36.6-104.9-128.0 152.7 58.8 95.7 29.7 14 402 A E E -B 20 0B 59 37,-1.9 37,-0.4 -2,-0.3 2,-0.2 -0.618 43.1-176.3 -69.4 125.3 56.7 94.1 27.1 15 403 A T E >> -B 19 0B 3 4,-2.8 3,-1.4 -2,-0.4 4,-1.2 -0.727 39.5 -49.9-120.4 177.6 54.6 91.2 28.5 16 404 A M T 34 S+ 0 0 27 207,-2.8 -1,-0.1 1,-0.3 207,-0.1 -0.176 123.6 31.4 -56.6 133.6 52.2 88.7 27.0 17 405 A G T 34 S- 0 0 29 1,-0.1 -1,-0.3 131,-0.1 128,-0.1 0.362 125.7 -82.8 98.8 1.5 49.6 90.1 24.7 18 406 A G T <4 S+ 0 0 22 -3,-1.4 42,-2.9 1,-0.2 43,-0.4 0.834 87.1 141.1 74.9 27.1 51.9 93.0 23.6 19 407 A V E < -BD 15 59B 20 -4,-1.2 -4,-2.8 40,-0.2 2,-0.5 -0.698 53.7-117.3-100.4 158.1 51.2 95.2 26.6 20 408 A M E -B 14 0B 14 38,-2.3 2,-0.6 -2,-0.3 -6,-0.2 -0.843 21.8-159.2 -90.5 127.1 53.7 97.4 28.6 21 409 A T E -B 13 0B 24 -8,-3.2 -8,-2.4 -2,-0.5 2,-0.3 -0.958 18.4-135.8-104.9 121.9 54.1 96.4 32.2 22 410 A T E +B 12 0B 61 -2,-0.6 -10,-0.3 -10,-0.2 3,-0.1 -0.627 31.8 169.1 -83.9 131.0 55.5 99.3 34.1 23 411 A L E S+ 0 0 14 -12,-3.0 2,-0.5 -2,-0.3 -11,-0.2 0.621 78.1 37.1-103.3 -32.7 58.3 98.7 36.6 24 412 A I E S-B 11 0B 0 -13,-3.1 -13,-3.6 10,-0.0 -1,-0.3 -0.966 85.0-136.7-127.7 117.1 59.1 102.4 37.2 25 413 A A > - 0 0 54 -2,-0.5 3,-0.6 -15,-0.2 -18,-0.2 -0.416 32.1 -91.0 -71.2 136.4 56.2 104.9 37.3 26 414 A K T 3 S+ 0 0 68 1,-0.2 -1,-0.1 -2,-0.1 -16,-0.1 -0.106 110.3 24.4 -34.7 137.4 56.4 108.2 35.6 27 415 A N T 3 S+ 0 0 94 -20,-3.7 2,-0.4 1,-0.3 -1,-0.2 0.856 80.6 151.7 65.5 34.2 57.7 111.1 37.8 28 416 A T < - 0 0 29 -3,-0.6 -21,-2.5 -19,-0.2 2,-0.3 -0.831 45.6-126.6 -90.4 135.7 59.7 108.8 40.1 29 417 A T B -A 6 0A 75 -2,-0.4 -23,-0.2 -23,-0.2 -25,-0.0 -0.630 42.3 -95.5 -84.4 140.9 62.7 110.6 41.6 30 418 A I S S+ 0 0 23 -25,-1.6 -25,-0.3 -2,-0.3 2,-0.2 -0.804 95.0 60.9-112.1 156.5 66.0 108.8 41.1 31 419 A P S S+ 0 0 90 0, 0.0 2,-0.3 0, 0.0 60,-0.2 0.432 77.8 146.3 -64.3 150.3 68.0 106.8 42.3 32 420 A T E -F 90 0C 25 58,-1.9 58,-2.4 -2,-0.2 2,-0.3 -0.977 32.2-161.8-155.9 153.7 65.3 104.2 42.5 33 421 A K E +F 89 0C 134 -2,-0.3 2,-0.3 56,-0.2 56,-0.2 -0.974 13.9 171.2-140.9 126.9 65.1 100.3 42.2 34 422 A H E -F 88 0C 85 54,-2.6 54,-3.1 -2,-0.3 2,-0.3 -0.987 5.7-175.8-133.5 150.2 62.0 98.2 41.6 35 423 A S E -F 87 0C 62 -2,-0.3 2,-0.3 52,-0.3 52,-0.2 -0.974 7.2-172.7-142.2 155.9 61.5 94.6 40.8 36 424 A Q E -F 86 0C 65 50,-2.3 50,-3.0 -2,-0.3 2,-0.7 -0.995 25.4-123.7-146.0 147.4 58.8 92.3 39.9 37 425 A V E +F 85 0C 50 -2,-0.3 185,-0.4 48,-0.2 48,-0.3 -0.810 33.6 178.7 -98.4 120.9 58.7 88.5 39.5 38 426 A F E -F 84 0C 0 46,-4.0 46,-2.8 -2,-0.7 2,-0.3 -0.498 9.4-156.4-106.1 177.0 57.4 87.3 36.2 39 427 A S E -i 223 0D 1 183,-2.0 185,-1.9 44,-0.2 2,-0.2 -0.834 29.4 -72.4-141.2-171.9 57.0 83.8 34.8 40 428 A T E -i 224 0D 1 -2,-0.3 40,-1.4 183,-0.2 8,-0.1 -0.522 20.1-147.8 -90.8 151.2 56.8 82.1 31.3 41 429 A A S S+ 0 0 3 183,-1.3 2,-0.3 -2,-0.2 38,-0.1 0.713 78.9 48.3 -82.5 -28.5 54.0 82.2 28.8 42 430 A E S > S- 0 0 86 182,-0.3 3,-1.3 36,-0.1 38,-0.2 -0.861 88.1-101.5-123.3 152.0 54.5 78.7 27.3 43 431 A D T 3 S+ 0 0 66 -2,-0.3 -2,-0.1 1,-0.3 -1,-0.0 -0.422 109.5 8.4 -64.6 139.5 55.0 75.2 28.7 44 432 A N T 3 S+ 0 0 108 33,-3.6 2,-0.3 1,-0.2 -1,-0.3 0.779 86.2 172.7 62.0 26.8 58.7 74.2 28.5 45 433 A Q < - 0 0 11 -3,-1.3 -1,-0.2 32,-0.4 -5,-0.1 -0.599 17.6-166.4 -72.0 128.1 59.7 77.7 27.5 46 434 A S + 0 0 81 -2,-0.3 28,-2.7 1,-0.1 2,-0.3 0.594 63.9 13.5 -91.9 -8.6 63.6 77.9 27.5 47 435 A A - 0 0 11 26,-0.2 2,-0.4 25,-0.2 25,-0.3 -0.965 59.4-141.7-164.0 159.8 64.1 81.7 27.4 48 436 A V E - E 0 71B 0 23,-2.1 23,-2.7 -2,-0.3 2,-0.5 -0.963 18.2-134.1-134.4 139.5 62.3 85.0 27.8 49 437 A T E - E 0 70B 29 176,-1.9 2,-0.7 -2,-0.4 21,-0.2 -0.882 15.3-152.6 -92.6 128.6 62.8 88.1 25.7 50 438 A I E - E 0 69B 0 19,-3.6 19,-1.8 -2,-0.5 2,-0.8 -0.916 13.0-174.0-107.8 100.2 63.1 91.2 27.8 51 439 A H E - E 0 68B 38 -2,-0.7 -37,-1.9 -37,-0.4 2,-0.3 -0.892 14.6-147.5-103.3 105.3 62.0 94.2 25.7 52 440 A V E -CE 13 67B 0 15,-1.8 14,-2.5 -2,-0.8 15,-1.0 -0.562 19.5-169.2 -80.7 129.5 62.6 97.4 27.7 53 441 A L E -CE 12 65B 1 -41,-3.5 -41,-2.8 -2,-0.3 2,-0.5 -0.940 18.7-162.2-127.0 143.0 60.1 100.2 27.0 54 442 A Q E +CE 11 64B 18 10,-2.9 10,-3.6 -2,-0.4 2,-0.3 -0.994 50.6 69.3-120.4 125.2 59.7 103.9 27.7 55 443 A G S S- 0 0 0 -45,-2.4 -45,-0.1 -2,-0.5 8,-0.1 -0.916 73.8-103.3 155.8 177.5 56.3 105.5 27.4 56 444 A E S S+ 0 0 46 -2,-0.3 2,-0.2 6,-0.2 7,-0.1 0.312 75.7 110.9-114.4 6.5 52.7 105.8 28.7 57 445 A R - 0 0 21 2,-0.1 -37,-0.2 1,-0.1 6,-0.1 -0.498 62.9-140.0 -88.5 152.8 50.9 103.7 26.2 58 446 A K S S+ 0 0 69 -2,-0.2 -38,-2.3 -39,-0.1 2,-0.4 0.912 87.4 75.1 -77.4 -40.4 49.2 100.4 27.0 59 447 A R B > S-D 19 0B 108 -40,-0.2 3,-1.4 1,-0.1 4,-0.3 -0.567 78.1-143.4 -71.3 127.3 50.3 98.8 23.7 60 448 A A G > S+ 0 0 1 -42,-2.9 3,-2.1 -2,-0.4 -1,-0.1 0.899 100.6 59.2 -56.3 -43.4 54.0 97.9 23.8 61 449 A A G 3 S+ 0 0 94 -43,-0.4 -1,-0.3 1,-0.3 4,-0.1 0.744 99.2 59.2 -59.3 -25.1 54.4 98.9 20.1 62 450 A D G < S+ 0 0 61 -3,-1.4 -1,-0.3 2,-0.1 -6,-0.2 0.472 97.3 76.1 -83.3 -5.6 53.2 102.5 21.0 63 451 A N S < S- 0 0 16 -3,-2.1 2,-0.5 -4,-0.3 -8,-0.2 -0.449 93.9 -90.5 -99.1 171.1 56.0 103.0 23.4 64 452 A K E -E 54 0B 83 -10,-3.6 -10,-2.9 -2,-0.2 2,-0.7 -0.743 35.8-132.4 -82.6 128.1 59.7 103.8 22.9 65 453 A S E -E 53 0B 56 -2,-0.5 -12,-0.2 -12,-0.2 53,-0.2 -0.670 22.0-177.7 -78.9 114.8 61.9 100.8 22.6 66 454 A L E - 0 0 28 -14,-2.5 2,-0.3 -2,-0.7 -13,-0.2 0.626 56.9 -84.3 -85.6 -14.9 65.0 101.2 24.8 67 455 A G E -E 52 0B 21 -15,-1.0 -15,-1.8 46,-0.1 -1,-0.4 -0.850 44.1-126.8 146.4-173.9 66.5 97.8 23.6 68 456 A Q E -E 51 0B 101 -2,-0.3 2,-0.3 -17,-0.2 -17,-0.2 -0.987 16.0-178.2-166.5 168.7 66.2 94.3 24.5 69 457 A F E -E 50 0B 26 -19,-1.8 -19,-3.6 -2,-0.3 2,-0.3 -0.966 23.2-118.7-161.6 163.1 67.9 91.0 25.5 70 458 A N E -E 49 0B 75 -2,-0.3 2,-0.5 -21,-0.2 -21,-0.2 -0.808 5.7-154.0-112.7 152.3 67.1 87.4 26.2 71 459 A L E +E 48 0B 0 -23,-2.7 -23,-2.1 -2,-0.3 3,-0.2 -0.990 28.1 174.4-118.8 119.2 67.6 85.3 29.3 72 460 A D + 0 0 94 -2,-0.5 -25,-0.2 -25,-0.3 3,-0.1 -0.235 43.7 75.5-108.6-163.3 67.9 81.6 28.3 73 461 A G + 0 0 34 1,-0.2 2,-0.5 -27,-0.1 -26,-0.2 0.698 55.8 162.0 67.7 23.0 68.6 78.3 30.2 74 462 A I - 0 0 11 -28,-2.7 -1,-0.2 -3,-0.2 3,-0.1 -0.598 39.6-123.3 -73.2 126.4 65.2 78.2 31.7 75 463 A N - 0 0 83 -2,-0.5 -30,-0.1 1,-0.1 -31,-0.1 -0.355 39.3 -78.4 -73.5 149.4 64.7 74.6 32.9 76 464 A P S S+ 0 0 106 0, 0.0 -1,-0.1 0, 0.0 -33,-0.1 -0.241 72.0 144.7 -53.0 127.3 61.6 72.6 31.6 77 465 A A - 0 0 28 -35,-0.1 -33,-3.6 -3,-0.1 -32,-0.4 -0.965 54.0 -89.3-157.5 157.5 58.5 73.7 33.5 78 466 A P > - 0 0 62 0, 0.0 3,-1.5 0, 0.0 -38,-0.2 -0.358 63.9 -84.9 -62.7 148.4 54.7 74.3 33.0 79 467 A R T 3 S+ 0 0 33 1,-0.2 -38,-0.2 -38,-0.1 -36,-0.1 -0.299 116.0 26.0 -47.9 143.6 53.9 77.8 31.9 80 468 A G T 3 S+ 0 0 15 -40,-1.4 -1,-0.2 -38,-0.2 -39,-0.1 0.438 99.9 90.8 83.8 -4.7 53.6 80.2 34.8 81 469 A M < + 0 0 126 -3,-1.5 -2,-0.1 -41,-0.1 -1,-0.1 0.861 60.3 86.4 -91.2 -44.6 55.9 78.3 37.1 82 470 A P S S- 0 0 16 0, 0.0 2,-0.7 0, 0.0 -42,-0.1 -0.172 71.9-135.8 -55.1 148.5 59.4 79.7 36.5 83 471 A Q + 0 0 102 -44,-0.1 20,-2.7 2,-0.0 2,-0.6 -0.942 25.3 176.9-111.1 104.9 60.4 82.8 38.5 84 472 A I E -FG 38 102C 0 -46,-2.8 -46,-4.0 -2,-0.7 2,-0.6 -0.949 15.5-156.7-107.1 106.5 62.0 85.4 36.4 85 473 A E E -FG 37 101C 35 16,-3.0 16,-1.9 -2,-0.6 2,-0.5 -0.800 4.6-162.2 -92.8 127.9 62.7 88.4 38.5 86 474 A V E -FG 36 100C 0 -50,-3.0 -50,-2.3 -2,-0.6 2,-0.4 -0.933 6.3-170.2-114.8 123.0 63.1 91.6 36.6 87 475 A T E -FG 35 99C 18 12,-2.1 12,-2.4 -2,-0.5 2,-0.6 -0.966 11.5-162.8-116.0 126.4 64.8 94.6 38.3 88 476 A F E +FG 34 98C 0 -54,-3.1 -54,-2.6 -2,-0.4 2,-0.5 -0.976 15.3 179.5-102.8 118.8 64.9 98.2 37.0 89 477 A D E -FG 33 97C 49 8,-2.3 8,-2.8 -2,-0.6 2,-0.6 -0.962 9.4-171.7-118.4 112.4 67.6 100.1 38.8 90 478 A I E -FG 32 96C 11 -58,-2.4 -58,-1.9 -2,-0.5 6,-0.2 -0.906 18.4-155.4-101.3 121.4 68.2 103.8 37.9 91 479 A D > - 0 0 37 4,-2.3 3,-2.3 -2,-0.6 -61,-0.0 -0.273 35.5 -86.5 -88.5 178.5 71.3 105.1 39.6 92 480 A A T 3 S+ 0 0 72 1,-0.3 -62,-0.1 2,-0.1 -1,-0.1 0.739 127.3 57.7 -54.4 -25.4 72.4 108.6 40.6 93 481 A D T 3 S- 0 0 123 2,-0.1 -1,-0.3 1,-0.0 22,-0.2 0.445 117.6-113.1 -84.7 -0.5 73.9 109.1 37.1 94 482 A G < + 0 0 23 -3,-2.3 2,-0.4 1,-0.3 -2,-0.1 0.658 68.6 145.0 74.6 20.5 70.5 108.4 35.6 95 483 A I - 0 0 46 19,-0.1 -4,-2.3 20,-0.1 2,-0.6 -0.756 43.0-138.8 -93.2 133.5 71.7 105.2 34.0 96 484 A L E -GH 90 113C 8 17,-2.5 17,-3.4 -2,-0.4 2,-0.6 -0.847 14.3-167.3 -93.8 123.8 69.1 102.4 33.9 97 485 A H E -GH 89 112C 59 -8,-2.8 -8,-2.3 -2,-0.6 2,-0.5 -0.949 6.8-170.6-104.0 119.5 70.3 98.8 34.7 98 486 A V E -GH 88 111C 0 13,-3.3 13,-2.6 -2,-0.6 2,-0.3 -0.944 6.9-179.8-110.2 128.6 67.7 96.2 33.8 99 487 A S E -GH 87 110C 14 -12,-2.4 -12,-2.1 -2,-0.5 2,-0.4 -0.951 18.5-161.9-124.8 157.4 68.2 92.6 34.8 100 488 A A E -GH 86 109C 0 9,-2.4 9,-2.3 -2,-0.3 2,-0.4 -0.999 18.2-176.6-131.8 126.5 66.3 89.3 34.4 101 489 A K E -GH 85 108C 78 -16,-1.9 -16,-3.0 -2,-0.4 2,-0.7 -0.993 23.4-139.2-132.6 133.4 67.2 86.6 36.8 102 490 A D E > -G 84 0C 2 5,-2.9 4,-2.5 -2,-0.4 -18,-0.2 -0.815 10.1-157.6 -95.6 119.8 66.0 83.0 37.0 103 491 A K T 4 S+ 0 0 102 -20,-2.7 -1,-0.2 -2,-0.7 -19,-0.1 0.676 90.4 54.1 -76.8 -18.9 65.4 82.1 40.7 104 492 A N T 4 S+ 0 0 109 -21,-0.4 -1,-0.2 1,-0.1 -20,-0.1 0.938 124.7 20.4 -71.9 -47.4 65.7 78.4 39.9 105 493 A S T 4 S- 0 0 46 2,-0.1 -2,-0.2 -30,-0.0 3,-0.1 0.575 92.5-131.8-103.8 -12.7 69.1 78.5 38.1 106 494 A G < + 0 0 49 -4,-2.5 -3,-0.1 1,-0.3 -2,-0.0 0.368 55.6 149.0 72.6 -7.3 70.4 81.7 39.4 107 495 A K - 0 0 88 -5,-0.2 -5,-2.9 -34,-0.1 2,-0.3 -0.322 24.8-171.8 -59.1 142.3 71.3 82.7 35.8 108 496 A E E -H 101 0C 75 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.2 -0.992 15.4-172.5-140.5 142.6 71.1 86.4 35.1 109 497 A Q E -H 100 0C 85 -9,-2.3 -9,-2.4 -2,-0.3 2,-0.3 -0.983 13.1-164.5-131.9 147.2 71.3 88.7 32.1 110 498 A K E -H 99 0C 126 -2,-0.3 2,-0.4 -11,-0.2 -11,-0.2 -0.951 16.5-159.5-128.7 152.4 71.4 92.5 32.0 111 499 A I E -H 98 0C 36 -13,-2.6 -13,-3.3 -2,-0.3 2,-0.5 -0.986 14.6-153.0-123.8 141.6 70.9 95.5 29.7 112 500 A T E -H 97 0C 94 -2,-0.4 2,-0.5 -15,-0.2 -15,-0.2 -0.971 8.7-163.6-111.9 128.0 72.4 98.9 30.6 113 501 A I E -H 96 0C 11 -17,-3.4 -17,-2.5 -2,-0.5 -46,-0.1 -0.970 18.7-124.8-118.6 114.5 70.7 101.9 29.2 114 502 A K > - 0 0 134 -2,-0.5 3,-2.1 -19,-0.2 -19,-0.1 -0.286 22.6-114.6 -54.7 146.7 72.5 105.3 29.1 115 503 A A T 3 S+ 0 0 64 1,-0.3 -1,-0.1 -22,-0.2 -20,-0.1 0.747 116.1 54.8 -53.3 -29.3 70.9 108.4 30.7 116 504 A S T 3 S+ 0 0 99 2,-0.0 -1,-0.3 4,-0.0 -21,-0.1 0.480 87.2 101.7 -89.6 -6.0 70.6 110.0 27.3 117 505 A S < + 0 0 49 -3,-2.1 2,-0.2 3,-0.0 -51,-0.1 -0.239 62.6 36.5 -69.2 167.7 68.7 107.1 25.6 118 506 A G S S- 0 0 23 -53,-0.2 2,-0.2 -52,-0.0 -53,-0.1 -0.503 100.8 -5.6 92.5-154.9 65.0 107.2 25.0 119 507 A L - 0 0 24 -2,-0.2 -110,-0.0 1,-0.1 2,-0.0 -0.534 62.2-130.2 -86.0 139.6 62.7 110.0 23.9 120 508 A N > - 0 0 79 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.239 39.7 -90.9 -74.1 171.9 63.8 113.6 23.6 121 509 A E H > S+ 0 0 147 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.877 127.1 50.4 -54.9 -40.9 61.9 116.4 25.2 122 510 A D H > S+ 0 0 118 2,-0.2 4,-2.5 1,-0.2 3,-0.3 0.980 113.4 44.9 -56.6 -58.6 59.7 117.0 22.1 123 511 A E H > S+ 0 0 69 1,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.792 108.7 57.9 -59.9 -33.6 58.8 113.3 21.8 124 512 A I H X S+ 0 0 27 -4,-2.6 4,-3.0 2,-0.2 5,-0.3 0.940 109.7 44.0 -61.3 -46.5 58.2 113.1 25.6 125 513 A Q H X S+ 0 0 99 -4,-2.0 4,-2.1 -3,-0.3 -2,-0.2 0.915 111.4 52.9 -69.9 -38.7 55.5 115.8 25.2 126 514 A K H X S+ 0 0 124 -4,-2.5 4,-3.0 2,-0.2 -1,-0.2 0.908 112.5 47.6 -54.7 -40.6 54.2 114.1 22.1 127 515 A M H X S+ 0 0 17 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.917 110.3 47.6 -71.0 -48.7 53.9 110.9 24.2 128 516 A V H X S+ 0 0 37 -4,-3.0 4,-1.8 2,-0.2 -1,-0.2 0.913 115.8 50.6 -56.0 -38.2 52.2 112.4 27.3 129 517 A R H X S+ 0 0 138 -4,-2.1 4,-2.6 -5,-0.3 3,-0.2 0.962 110.4 44.8 -66.8 -58.0 49.9 114.0 24.7 130 518 A D H X S+ 0 0 65 -4,-3.0 4,-1.7 1,-0.2 -1,-0.2 0.844 108.4 58.6 -54.4 -40.6 49.0 110.8 22.8 131 519 A A H < S+ 0 0 16 -4,-2.5 -1,-0.2 2,-0.2 -2,-0.2 0.911 112.2 39.7 -61.8 -41.2 48.5 108.8 26.1 132 520 A E H >< S+ 0 0 151 -4,-1.8 3,-1.3 -3,-0.2 4,-0.3 0.923 114.9 53.8 -68.6 -41.3 45.8 111.3 27.2 133 521 A A H 3< S+ 0 0 76 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.712 119.9 33.8 -62.7 -23.4 44.4 111.5 23.5 134 522 A N T 3X S+ 0 0 55 -4,-1.7 4,-3.3 -5,-0.2 5,-0.3 0.183 79.4 119.5-118.4 18.5 44.2 107.7 23.5 135 523 A A H <> S+ 0 0 58 -3,-1.3 4,-1.9 1,-0.2 -2,-0.1 0.851 80.6 45.5 -54.3 -39.0 43.2 107.0 27.1 136 524 A E H > S+ 0 0 108 -4,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.921 113.8 46.9 -72.2 -46.5 40.0 105.4 26.1 137 525 A A H > S+ 0 0 54 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.915 113.5 50.3 -60.9 -42.6 41.4 103.3 23.3 138 526 A D H X S+ 0 0 12 -4,-3.3 4,-2.6 1,-0.2 -1,-0.2 0.890 108.0 52.7 -63.7 -40.6 44.2 102.2 25.6 139 527 A R H X S+ 0 0 97 -4,-1.9 4,-2.1 -5,-0.3 -1,-0.2 0.916 110.0 49.1 -61.3 -38.9 41.7 101.3 28.3 140 528 A K H X S+ 0 0 115 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.843 109.8 50.7 -68.0 -38.4 39.8 99.1 25.7 141 529 A F H X S+ 0 0 10 -4,-2.3 4,-2.8 2,-0.2 5,-0.3 0.893 107.8 53.4 -67.1 -38.3 43.0 97.4 24.6 142 530 A E H X S+ 0 0 85 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.938 109.3 48.6 -60.7 -40.3 43.8 96.7 28.3 143 531 A E H X S+ 0 0 63 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.924 112.5 48.9 -66.6 -43.0 40.4 95.0 28.7 144 532 A L H X S+ 0 0 19 -4,-2.2 4,-3.1 2,-0.2 5,-0.2 0.944 113.5 44.9 -57.3 -49.0 40.9 93.0 25.5 145 533 A V H X S+ 0 0 4 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.921 113.5 50.4 -68.1 -39.3 44.4 91.8 26.4 146 534 A Q H X S+ 0 0 116 -4,-2.8 4,-2.1 -5,-0.3 -1,-0.2 0.928 112.6 47.9 -62.1 -43.5 43.3 91.0 30.0 147 535 A T H X S+ 0 0 5 -4,-2.5 4,-2.1 -5,-0.2 -2,-0.2 0.930 113.4 46.4 -63.4 -47.4 40.3 89.0 28.5 148 536 A R H X S+ 0 0 36 -4,-3.1 4,-2.8 1,-0.2 -1,-0.2 0.901 111.5 52.3 -62.2 -40.7 42.5 87.1 26.0 149 537 A N H X S+ 0 0 47 -4,-2.8 4,-1.9 -5,-0.2 -1,-0.2 0.898 111.7 46.9 -63.4 -37.3 45.1 86.3 28.7 150 538 A Q H X S+ 0 0 99 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.824 112.2 48.6 -68.7 -36.7 42.2 84.9 30.9 151 539 A G H X S+ 0 0 0 -4,-2.1 4,-3.3 2,-0.2 -2,-0.2 0.905 108.5 53.0 -74.7 -41.6 40.8 82.9 28.2 152 540 A D H X S+ 0 0 25 -4,-2.8 4,-2.8 2,-0.2 5,-0.3 0.928 110.1 50.6 -52.7 -48.5 44.3 81.5 27.3 153 541 A H H X S+ 0 0 108 -4,-1.9 4,-2.9 1,-0.2 5,-0.3 0.951 112.9 44.6 -57.9 -43.6 44.5 80.5 31.1 154 542 A L H X S+ 0 0 53 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.926 111.8 53.6 -65.2 -45.2 41.1 78.8 30.9 155 543 A L H X S+ 0 0 5 -4,-3.3 4,-2.2 1,-0.2 -2,-0.2 0.968 116.8 37.4 -47.0 -56.9 42.1 77.1 27.6 156 544 A H H X S+ 0 0 33 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.889 115.9 49.9 -73.2 -40.3 45.2 75.7 29.0 157 545 A S H X S+ 0 0 31 -4,-2.9 4,-2.5 -5,-0.3 5,-0.2 0.975 111.9 49.8 -63.3 -48.7 44.0 74.8 32.5 158 546 A T H X S+ 0 0 3 -4,-2.7 4,-2.3 -5,-0.3 -2,-0.2 0.890 108.4 52.5 -56.4 -45.2 41.0 73.1 31.0 159 547 A R H X S+ 0 0 74 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.915 110.6 47.8 -58.0 -44.3 43.1 71.0 28.6 160 548 A K H X S+ 0 0 87 -4,-2.1 4,-3.2 1,-0.2 -1,-0.2 0.910 111.4 51.0 -57.6 -44.6 45.3 69.9 31.5 161 549 A Q H X S+ 0 0 55 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.874 107.4 53.0 -64.5 -37.0 42.2 69.0 33.5 162 550 A V H X S+ 0 0 11 -4,-2.3 4,-2.1 -5,-0.2 3,-0.3 0.996 111.8 45.7 -58.9 -61.8 40.8 66.9 30.6 163 551 A E H < S+ 0 0 153 -4,-2.2 3,-0.3 1,-0.2 -2,-0.2 0.922 114.5 47.4 -44.8 -56.4 44.1 64.9 30.4 164 552 A E H < S+ 0 0 102 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.884 109.6 56.0 -57.3 -38.2 44.2 64.4 34.2 165 553 A A H >< S+ 0 0 4 -4,-2.5 3,-2.2 -3,-0.3 -1,-0.2 0.872 76.5 162.1 -59.8 -44.5 40.5 63.4 34.2 166 554 A G G >< S- 0 0 43 -4,-2.1 3,-1.6 1,-0.3 -1,-0.2 -0.303 73.0 -7.7 61.6-134.9 41.0 60.5 31.7 167 555 A D G 3 S+ 0 0 166 1,-0.3 -1,-0.3 3,-0.0 4,-0.1 0.488 119.6 82.0 -72.4 -8.4 38.0 58.2 31.8 168 556 A K G < S+ 0 0 131 -3,-2.2 -1,-0.3 -4,-0.1 -2,-0.2 0.804 80.3 80.4 -63.0 -23.3 36.6 59.9 34.8 169 557 A L S < S- 0 0 9 -3,-1.6 5,-0.1 -7,-0.2 -1,-0.0 -0.729 89.2-122.8 -90.7 117.4 35.1 62.4 32.2 170 558 A P > - 0 0 54 0, 0.0 4,-2.3 0, 0.0 5,-0.2 -0.199 21.1-117.2 -55.1 148.3 31.9 61.1 30.4 171 559 A A H > S+ 0 0 74 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.937 113.8 52.1 -52.2 -52.6 32.1 61.0 26.5 172 560 A D H > S+ 0 0 136 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.865 110.2 49.6 -56.8 -43.4 29.4 63.6 26.0 173 561 A D H > S+ 0 0 41 2,-0.2 4,-3.1 1,-0.2 -1,-0.3 0.906 111.0 48.6 -55.6 -47.1 31.2 66.0 28.4 174 562 A K H X S+ 0 0 91 -4,-2.3 4,-2.7 2,-0.2 5,-0.3 0.910 110.2 51.8 -65.9 -38.8 34.5 65.5 26.5 175 563 A T H X S+ 0 0 97 -4,-2.8 4,-1.9 2,-0.2 5,-0.2 0.968 115.2 41.7 -57.4 -50.0 32.8 66.1 23.2 176 564 A A H X S+ 0 0 35 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.931 115.6 50.4 -69.5 -44.4 31.2 69.4 24.4 177 565 A I H X S+ 0 0 0 -4,-3.1 4,-2.3 29,-0.2 -1,-0.2 0.917 111.7 45.7 -59.2 -42.1 34.4 70.5 26.2 178 566 A E H X S+ 0 0 78 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.828 110.6 52.2 -76.1 -32.0 36.8 69.9 23.3 179 567 A S H X S+ 0 0 71 -4,-1.9 4,-2.3 -5,-0.3 -1,-0.2 0.938 113.2 45.7 -70.0 -36.8 34.6 71.6 20.7 180 568 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.848 111.5 52.4 -69.9 -38.8 34.3 74.6 23.1 181 569 A L H X S+ 0 0 4 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.929 109.5 49.6 -61.6 -46.6 38.1 74.5 23.7 182 570 A T H X S+ 0 0 80 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.956 112.7 46.6 -57.5 -47.1 38.7 74.5 19.9 183 571 A A H X S+ 0 0 27 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.870 111.7 50.7 -64.6 -39.8 36.4 77.4 19.4 184 572 A L H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.924 107.6 53.8 -60.7 -43.5 38.0 79.3 22.3 185 573 A E H < S+ 0 0 80 -4,-2.8 4,-0.4 1,-0.2 -2,-0.2 0.882 110.8 47.5 -57.0 -40.0 41.5 78.7 20.8 186 574 A T H >< S+ 0 0 81 -4,-2.0 3,-1.3 -5,-0.2 4,-0.4 0.901 110.2 50.6 -66.3 -41.8 40.2 80.2 17.5 187 575 A A H >< S+ 0 0 14 -4,-2.0 3,-1.0 1,-0.3 5,-0.4 0.800 102.1 62.1 -67.9 -29.0 38.6 83.3 19.2 188 576 A L T 3< S+ 0 0 19 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.672 93.5 65.8 -72.2 -13.7 41.9 83.9 21.1 189 577 A K T < S+ 0 0 172 -3,-1.3 -1,-0.2 -4,-0.4 -2,-0.2 0.678 101.4 55.5 -78.3 -24.1 43.5 84.4 17.6 190 578 A G S < S- 0 0 27 -3,-1.0 -3,-0.0 -4,-0.4 0, 0.0 -0.174 84.2-118.8 -94.8-168.1 41.5 87.5 17.0 191 579 A E + 0 0 135 -2,-0.1 2,-0.7 -43,-0.0 3,-0.1 -0.281 68.8 119.4-126.6 47.6 40.9 90.8 18.7 192 580 A D > - 0 0 90 -5,-0.4 4,-1.8 1,-0.2 5,-0.2 -0.922 41.8-169.7-113.4 103.4 37.2 90.6 19.3 193 581 A K H > S+ 0 0 69 -2,-0.7 4,-2.7 1,-0.2 5,-0.3 0.928 85.6 55.2 -62.4 -43.2 36.7 90.7 23.0 194 582 A A H > S+ 0 0 64 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.895 106.9 52.2 -56.3 -44.2 32.9 89.7 22.8 195 583 A A H > S+ 0 0 32 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.886 110.3 47.0 -58.0 -48.3 33.9 86.6 20.8 196 584 A I H X S+ 0 0 0 -4,-1.8 4,-2.5 -9,-0.2 -1,-0.2 0.947 111.8 49.2 -62.3 -48.1 36.4 85.5 23.4 197 585 A E H X S+ 0 0 86 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.885 109.0 54.9 -59.7 -33.6 34.0 86.1 26.3 198 586 A A H X S+ 0 0 51 -4,-2.3 4,-2.0 -5,-0.3 -1,-0.2 0.913 110.1 45.0 -71.3 -36.8 31.3 84.1 24.3 199 587 A K H X S+ 0 0 69 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.872 112.1 52.1 -70.0 -39.7 33.6 81.0 24.0 200 588 A M H X S+ 0 0 31 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.871 109.5 50.6 -56.6 -47.0 34.7 81.3 27.6 201 589 A Q H X S+ 0 0 124 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.880 108.8 51.2 -54.6 -47.1 31.0 81.3 28.6 202 590 A E H X S+ 0 0 58 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.963 110.0 49.6 -58.3 -45.4 30.4 78.2 26.4 203 591 A L H X S+ 0 0 2 -4,-2.6 4,-1.4 1,-0.3 -2,-0.2 0.919 110.0 50.6 -63.4 -42.9 33.2 76.5 28.1 204 592 A A H < S+ 0 0 73 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.872 110.7 50.3 -61.6 -36.8 31.9 77.4 31.6 205 593 A Q H < S+ 0 0 128 -4,-2.1 3,-0.4 1,-0.2 -1,-0.2 0.883 117.0 37.9 -69.1 -37.4 28.5 76.1 30.6 206 594 A V H < S+ 0 0 42 -4,-2.1 3,-0.4 1,-0.2 4,-0.3 0.538 105.7 68.3 -91.0 -3.7 29.7 72.7 29.4 207 595 A S X + 0 0 4 -4,-1.4 4,-2.7 -5,-0.2 5,-0.3 0.261 59.0 109.1-104.0 11.2 32.5 72.0 31.9 208 596 A Q H > S+ 0 0 159 -3,-0.4 4,-1.2 1,-0.2 -1,-0.2 0.850 82.2 45.5 -61.7 -40.2 30.6 71.4 35.1 209 597 A K H > S+ 0 0 85 -3,-0.4 4,-2.5 2,-0.2 3,-0.4 0.934 113.1 52.2 -70.4 -43.1 31.2 67.8 35.4 210 598 A L H > S+ 0 0 0 -4,-0.3 4,-2.8 1,-0.2 -2,-0.2 0.876 107.4 52.1 -54.8 -44.7 34.9 68.3 34.5 211 599 A M H X S+ 0 0 82 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.802 109.4 50.8 -56.9 -36.0 35.2 71.0 37.3 212 600 A E H X S+ 0 0 90 -4,-1.2 4,-2.7 -3,-0.4 -2,-0.2 0.953 110.5 47.1 -73.3 -43.5 33.8 68.6 39.8 213 601 A I H X S+ 0 0 8 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.955 115.2 46.9 -60.4 -48.0 36.3 65.8 38.8 214 602 A A H X S+ 0 0 14 -4,-2.8 4,-1.0 1,-0.2 -1,-0.2 0.864 111.4 50.7 -60.0 -41.0 39.3 68.3 38.9 215 603 A Q H >< S+ 0 0 114 -4,-2.1 3,-0.6 -5,-0.2 4,-0.3 0.943 113.5 46.6 -62.5 -45.0 38.1 69.6 42.3 216 604 A Q H >< S+ 0 0 108 -4,-2.7 3,-1.7 1,-0.2 -2,-0.2 0.902 101.2 64.1 -63.9 -42.2 37.9 66.1 43.6 217 605 A Q H 3< S+ 0 0 52 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.785 117.5 28.9 -53.8 -29.8 41.3 64.9 42.2 218 606 A H T << 0 0 131 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.268 360.0 360.0-115.5 15.3 43.0 67.4 44.5 219 607 A A < 0 0 125 -3,-1.7 -2,-0.1 -4,-0.3 -1,-0.1 0.653 360.0 360.0 -71.8 360.0 40.5 67.5 47.4 220 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 221 5 B P 0 0 109 0, 0.0 2,-0.3 0, 0.0 -183,-0.2 0.000 360.0 360.0 360.0 150.2 52.4 86.4 37.8 222 6 B V - 0 0 55 -185,-0.4 -183,-2.0 1,-0.1 2,-0.3 -0.607 360.0-123.6 -84.7 148.6 52.4 88.1 34.5 223 7 B Y E -i 39 0D 50 -2,-0.3 -207,-2.8 -185,-0.2 -183,-0.2 -0.645 13.6-152.7-106.5 149.7 54.0 86.2 31.6 224 8 B I E -i 40 0D 0 -185,-1.9 -183,-1.3 -2,-0.3 -182,-0.3 -0.946 21.5-127.7-118.3 131.7 56.8 87.0 29.3 225 9 B P - 0 0 39 0, 0.0 -176,-1.9 0, 0.0 -211,-0.0 -0.337 28.7-102.1 -72.9 160.5 56.9 85.5 25.8 226 10 B P 0 0 57 0, 0.0 -178,-0.2 0, 0.0 -181,-0.0 -0.259 360.0 360.0 -74.8 168.2 60.0 83.7 24.4 227 11 B P 0 0 86 0, 0.0 -180,-0.1 0, 0.0 -178,-0.0 -0.300 360.0 360.0 -65.2 360.0 62.4 85.2 22.0